7-chloranyl-2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one Openeye Name: 7-chloro-2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-(tetrahydrofuran-2-ylmethyl)quinazolin-4-one CAS Name: 7-chloro-2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-(2-oxolanylmethyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one Traditional Name: 7-chloro-2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]-3-(tetrahydrofurfuryl)quinazolin-4-one Formula: C25H23ClN2O4S MolecularWeight: 482.97912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC5CCCO5)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC5CCCO5)C

InChI

InChI=1S/C25H23ClN2O4S/c1-14-8-20-16(10-23(29)32-22(20)9-15(14)2)13-33-25-27-21-11-17(26)5-6-19(21)24(30)28(25)12-18-4-3-7-31-18/h5-6,8-11,18H,3-4,7,12-13H2,1-2H3